==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 24-OCT-96 9ICX . COMPND 2 MOLECULE: DNA (5'-D(*CP*AP*TP*CP*TP*G)-3'); . SOURCE 2 SYNTHETIC: YES; . AUTHOR H.PELLETIER,M.R.SAWAYA . 327 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17924.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 226 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 8.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 22 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 120 36.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 1 1 1 4 1 0 0 2 1 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 9 A E 0 0 221 0, 0.0 38,-0.1 0, 0.0 39,-0.1 0.000 360.0 360.0 360.0 -13.8 67.3 58.0 57.0 2 10 A T + 0 0 122 37,-0.1 4,-0.2 3,-0.0 3,-0.1 0.154 360.0 82.3-169.8 -13.0 67.3 59.1 60.6 3 11 A L S S+ 0 0 55 1,-0.2 42,-0.5 36,-0.1 36,-0.0 0.611 113.4 15.1 -83.2 -7.0 65.1 62.1 60.4 4 12 A N S > S+ 0 0 13 40,-0.1 4,-2.5 35,-0.1 5,-0.2 0.122 88.6 131.1-151.9 25.8 61.9 60.2 60.5 5 13 A G H > + 0 0 20 2,-0.2 4,-2.3 1,-0.2 -2,-0.1 0.841 69.1 48.7 -46.5 -56.9 63.3 56.9 61.7 6 14 A G H > S+ 0 0 36 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.959 112.0 51.1 -54.2 -54.2 60.9 56.1 64.6 7 15 A I H > S+ 0 0 8 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.873 112.1 45.9 -51.6 -45.5 57.9 56.9 62.4 8 16 A T H X S+ 0 0 20 -4,-2.5 4,-1.7 1,-0.2 -1,-0.3 0.810 113.3 52.0 -71.4 -26.7 59.2 54.6 59.8 9 17 A D H X S+ 0 0 96 -4,-2.3 4,-1.9 -5,-0.2 -2,-0.2 0.927 108.8 45.7 -74.6 -38.8 59.9 52.1 62.4 10 18 A M H X S+ 0 0 4 -4,-3.0 4,-3.4 2,-0.2 3,-0.4 0.954 111.8 53.8 -60.7 -52.3 56.6 51.9 64.0 11 19 A L H X S+ 0 0 0 -4,-1.9 4,-2.8 1,-0.3 -1,-0.2 0.876 108.9 49.2 -48.1 -47.4 54.9 51.8 60.6 12 20 A T H X S+ 0 0 60 -4,-1.7 4,-2.6 2,-0.2 -1,-0.3 0.851 111.5 49.1 -62.8 -35.6 57.1 48.9 59.9 13 21 A E H X S+ 0 0 77 -4,-1.9 4,-1.6 -3,-0.4 -2,-0.2 0.953 112.7 47.8 -63.5 -52.5 56.1 47.3 63.2 14 22 A L H X S+ 0 0 0 -4,-3.4 4,-1.9 1,-0.2 -2,-0.2 0.891 111.8 50.4 -54.8 -48.6 52.5 47.9 62.5 15 23 A A H X S+ 0 0 4 -4,-2.8 4,-2.0 -5,-0.3 3,-0.3 0.961 104.6 55.6 -61.1 -51.0 52.8 46.5 59.1 16 24 A N H X S+ 0 0 85 -4,-2.6 4,-2.9 1,-0.3 5,-0.3 0.831 108.9 49.6 -49.8 -35.5 54.5 43.3 60.0 17 25 A F H X>S+ 0 0 37 -4,-1.6 4,-2.6 2,-0.2 5,-1.9 0.922 103.8 56.2 -70.0 -44.8 51.8 42.6 62.3 18 26 A E H <5S+ 0 0 7 -4,-1.9 6,-0.4 -3,-0.3 -2,-0.2 0.913 118.0 36.4 -52.9 -45.2 48.9 43.1 59.9 19 27 A K H <5S+ 0 0 75 -4,-2.0 -2,-0.2 5,-0.2 -1,-0.2 0.949 123.7 37.9 -73.5 -56.8 50.4 40.7 57.7 20 28 A N H <5S+ 0 0 21 -4,-2.9 84,-0.2 -5,-0.2 -3,-0.2 0.901 132.4 21.1 -62.4 -50.9 51.8 38.1 60.1 21 29 A V T <5S+ 0 0 31 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.1 0.917 127.5 38.0 -87.3 -59.7 49.1 38.1 62.7 22 30 A S S + 0 0 25 -6,-0.4 4,-5.5 1,-0.2 3,-0.3 -0.087 10.6 157.0 -42.4 50.7 45.5 42.2 56.7 25 33 A I H > S+ 0 0 86 -2,-2.6 4,-3.0 1,-0.3 5,-0.3 0.829 78.2 54.1 -50.2 -33.2 47.6 42.3 53.4 26 34 A H H > S+ 0 0 153 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.986 114.4 36.7 -66.6 -49.3 45.8 45.5 52.6 27 35 A K H > S+ 0 0 108 -3,-0.3 4,-2.4 2,-0.2 5,-0.2 0.877 116.8 57.8 -65.0 -42.2 46.6 47.2 55.8 28 36 A Y H X S+ 0 0 33 -4,-5.5 4,-1.5 1,-0.3 -2,-0.2 0.953 108.1 41.8 -56.6 -49.2 49.9 45.5 55.5 29 37 A N H X S+ 0 0 77 -4,-3.0 4,-1.7 -5,-0.3 -1,-0.3 0.854 109.6 64.8 -65.3 -30.3 50.6 47.0 52.2 30 38 A A H X S+ 0 0 29 -4,-1.7 4,-1.7 -5,-0.3 3,-0.3 0.954 100.2 47.5 -56.8 -54.1 49.2 50.2 53.6 31 39 A Y H X S+ 0 0 13 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.861 109.0 58.2 -56.5 -40.0 52.0 50.5 56.3 32 40 A R H X S+ 0 0 142 -4,-1.5 4,-2.6 -5,-0.2 -1,-0.2 0.858 104.0 44.9 -62.7 -41.2 54.6 49.9 53.7 33 41 A K H X S+ 0 0 87 -4,-1.7 4,-3.4 -3,-0.3 5,-0.2 0.935 112.6 55.6 -68.6 -38.3 54.0 52.6 51.3 34 42 A A H X S+ 0 0 0 -4,-1.7 4,-2.7 -5,-0.2 5,-0.3 0.935 109.9 42.6 -57.9 -51.5 53.7 54.9 54.1 35 43 A A H X S+ 0 0 9 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.947 112.3 56.5 -60.3 -43.0 57.0 54.1 55.5 36 44 A S H X S+ 0 0 59 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.923 112.4 39.8 -51.8 -50.5 58.4 54.1 52.1 37 45 A V H X S+ 0 0 31 -4,-3.4 4,-1.9 1,-0.2 -1,-0.2 0.887 114.9 49.9 -71.6 -35.9 57.2 57.7 51.4 38 46 A I H < S+ 0 0 0 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.837 105.6 62.7 -67.7 -28.1 58.0 59.1 54.9 39 47 A A H < S+ 0 0 48 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.855 107.3 39.5 -61.6 -42.4 61.4 57.5 54.4 40 48 A K H < S+ 0 0 173 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.902 88.0 119.1 -75.6 -38.6 62.3 59.7 51.4 41 49 A Y < - 0 0 40 -4,-1.9 4,-0.1 1,-0.2 -38,-0.1 -0.059 60.9-142.3 -42.1 111.4 60.7 62.7 52.8 42 50 A P + 0 0 80 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.232 67.8 56.7 -54.9 -6.7 63.2 65.4 53.3 43 51 A H S S- 0 0 112 -39,-0.0 2,-0.8 0, 0.0 -40,-0.0 -0.753 88.4 -87.7-132.5-175.3 62.2 67.0 56.5 44 52 A K - 0 0 120 -2,-0.3 2,-0.7 -40,-0.0 -40,-0.1 -0.775 44.1-131.6 -87.8 115.6 61.5 66.4 60.1 45 53 A I + 0 0 6 -2,-0.8 3,-0.1 -42,-0.5 -38,-0.1 -0.534 28.6 179.5 -68.7 116.6 57.9 65.4 60.3 46 54 A K + 0 0 151 -2,-0.7 2,-0.3 1,-0.2 -1,-0.2 0.555 57.9 6.0 -95.5 -5.7 56.5 67.6 63.1 47 55 A S > - 0 0 36 1,-0.2 4,-1.6 22,-0.0 -1,-0.2 -0.999 68.5-106.2-166.9 164.6 52.9 66.4 63.1 48 56 A G H >> S+ 0 0 0 -2,-0.3 4,-2.4 1,-0.2 3,-0.6 0.964 117.0 55.4 -60.8 -51.7 50.4 64.0 61.8 49 57 A A H 3> S+ 0 0 66 1,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.850 105.7 53.9 -48.4 -39.5 48.8 66.6 59.6 50 58 A E H 34 S+ 0 0 45 1,-0.2 -1,-0.3 2,-0.2 3,-0.3 0.872 110.2 46.5 -65.2 -39.5 52.1 67.3 58.0 51 59 A A H X< S+ 0 0 0 -4,-1.6 3,-3.0 -3,-0.6 -2,-0.2 0.948 100.6 63.7 -67.8 -47.2 52.4 63.7 57.2 52 60 A K H 3< S+ 0 0 97 -4,-2.4 5,-0.2 1,-0.3 -1,-0.2 0.779 87.3 76.3 -43.5 -35.9 48.9 63.3 55.8 53 61 A K T 3< S+ 0 0 174 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.592 85.9 81.7 -55.9 -13.4 50.0 65.7 53.2 54 62 A L S X S- 0 0 32 -3,-3.0 3,-0.7 -4,-0.1 2,-0.3 -0.595 92.4-103.0 -95.7 161.0 51.9 62.9 51.7 55 63 A P T 3 S+ 0 0 97 0, 0.0 -18,-0.1 0, 0.0 3,-0.1 -0.651 109.5 29.9 -81.2 137.6 50.5 60.1 49.5 56 64 A G T 3 S+ 0 0 25 -2,-0.3 2,-0.9 1,-0.2 -22,-0.2 0.040 98.5 112.3 97.6 -23.3 49.9 56.8 51.3 57 65 A V < + 0 0 10 -3,-0.7 -1,-0.2 -5,-0.2 2,-0.1 -0.779 44.0 166.8 -94.6 108.3 49.3 58.9 54.3 58 66 A G > - 0 0 30 -2,-0.9 4,-2.3 -3,-0.1 5,-0.2 -0.319 50.5 -84.2-105.3-174.7 45.8 58.8 55.5 59 67 A T H > S+ 0 0 87 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.926 121.8 51.1 -60.8 -47.9 43.8 59.8 58.5 60 68 A K H > S+ 0 0 124 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.876 114.4 43.1 -60.1 -38.8 44.5 56.6 60.4 61 69 A I H > S+ 0 0 13 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.822 108.2 57.4 -77.2 -34.1 48.2 56.8 60.0 62 70 A A H X S+ 0 0 7 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.838 106.0 54.9 -63.4 -29.3 48.2 60.5 60.7 63 71 A E H X S+ 0 0 127 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.945 107.7 45.2 -62.7 -54.3 46.6 59.5 63.9 64 72 A K H X S+ 0 0 37 -4,-1.5 4,-1.5 1,-0.3 5,-0.2 0.819 108.1 58.5 -62.2 -37.6 49.2 57.1 65.0 65 73 A I H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -1,-0.3 0.892 104.6 52.2 -66.0 -33.7 51.9 59.5 64.0 66 74 A D H >X S+ 0 0 71 -4,-1.4 4,-5.1 1,-0.2 3,-0.6 0.997 108.8 46.6 -64.4 -57.1 50.5 62.0 66.3 67 75 A E H 3X S+ 0 0 74 -4,-1.7 4,-1.8 1,-0.3 6,-0.6 0.748 115.4 49.8 -52.1 -28.6 50.4 59.7 69.5 68 76 A F H 3< S+ 0 0 58 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.843 115.9 39.0 -83.4 -33.3 53.8 58.7 68.7 69 77 A L H << S+ 0 0 61 -4,-1.8 -2,-0.2 -3,-0.6 -3,-0.2 0.916 116.9 52.9 -78.5 -40.6 55.1 62.1 68.3 70 78 A A H < S+ 0 0 83 -4,-5.1 2,-0.3 -5,-0.3 -3,-0.2 0.906 127.8 9.1 -55.6 -48.9 53.0 63.3 71.2 71 79 A T S < S- 0 0 68 -4,-1.8 2,-2.0 2,-0.4 -1,-0.2 -0.985 87.8-103.2-133.7 143.0 54.4 60.5 73.6 72 80 A G S S+ 0 0 71 -2,-0.3 2,-0.3 -3,-0.1 -4,-0.1 0.351 96.8 51.8 -53.2 19.5 57.3 58.2 73.0 73 81 A K - 0 0 86 -2,-2.0 2,-0.4 -6,-0.6 -2,-0.4 -0.940 65.9-134.1-152.6 176.8 54.8 55.4 72.3 74 82 A L > - 0 0 1 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 -1.000 18.3-144.5-130.3 125.9 51.9 54.0 70.6 75 83 A R H > S+ 0 0 179 -2,-0.4 4,-3.2 1,-0.2 5,-0.2 0.961 102.7 50.3 -54.4 -53.8 49.2 52.1 72.6 76 84 A K H > S+ 0 0 75 1,-0.3 4,-2.3 2,-0.3 -1,-0.2 0.824 109.5 51.0 -50.0 -42.5 48.6 49.6 69.9 77 85 A L H > S+ 0 0 3 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.943 112.2 48.1 -64.7 -43.5 52.3 49.0 69.6 78 86 A E H X S+ 0 0 72 -4,-2.5 4,-0.7 1,-0.2 3,-0.4 0.947 110.4 48.7 -62.3 -49.1 52.3 48.4 73.3 79 87 A K H >X S+ 0 0 132 -4,-3.2 4,-1.9 1,-0.2 3,-0.6 0.895 112.3 50.4 -57.4 -41.6 49.3 46.1 73.3 80 88 A I H 3< S+ 0 0 22 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.785 102.9 59.1 -67.2 -31.1 50.9 44.0 70.4 81 89 A R H 3< S+ 0 0 129 -4,-1.6 -1,-0.2 -3,-0.4 -2,-0.2 0.659 113.3 41.5 -72.5 -18.3 54.3 43.6 72.0 82 90 A Q H << S+ 0 0 134 -4,-0.7 -2,-0.2 -3,-0.6 -3,-0.1 0.953 82.9 104.7 -86.3 -70.6 52.6 41.9 74.9 83 91 A D X - 0 0 69 -4,-1.9 4,-2.3 1,-0.1 5,-0.2 0.235 59.0-151.7 -19.3 102.6 50.0 39.7 73.3 84 92 A D H > S+ 0 0 104 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.869 92.7 58.5 -55.4 -38.5 51.3 36.2 73.6 85 93 A T H > S+ 0 0 46 2,-0.2 4,-1.7 1,-0.2 3,-0.3 0.963 107.2 45.8 -56.3 -51.5 49.5 35.2 70.5 86 94 A S H > S+ 0 0 2 1,-0.3 4,-2.2 2,-0.2 3,-0.3 0.937 114.5 49.5 -55.2 -46.4 51.2 37.7 68.4 87 95 A S H X S+ 0 0 45 -4,-2.3 4,-1.1 1,-0.2 -1,-0.3 0.837 104.2 57.2 -66.9 -30.6 54.5 36.8 69.9 88 96 A S H X S+ 0 0 14 -4,-2.5 4,-2.9 -3,-0.3 -1,-0.2 0.854 107.9 49.3 -67.7 -30.7 54.0 33.1 69.4 89 97 A I H X S+ 0 0 6 -4,-1.7 4,-1.6 -3,-0.3 -2,-0.2 0.897 107.0 52.9 -71.9 -44.4 53.6 33.7 65.8 90 98 A N H < S+ 0 0 72 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.774 115.5 45.1 -63.8 -21.6 56.6 35.9 65.5 91 99 A F H >< S+ 0 0 60 -4,-1.1 3,-1.7 -5,-0.2 -2,-0.2 0.898 107.4 49.1 -86.0 -49.8 58.4 33.1 67.1 92 100 A L H >< S+ 0 0 0 -4,-2.9 3,-3.9 1,-0.3 6,-0.2 0.908 102.3 69.3 -56.1 -40.4 57.3 29.8 65.3 93 101 A T T 3< S+ 0 0 43 -4,-1.6 5,-0.3 1,-0.3 -1,-0.3 0.732 83.4 71.0 -48.8 -27.7 58.0 31.7 62.1 94 102 A R T < S+ 0 0 110 -3,-1.7 -1,-0.3 -5,-0.1 2,-0.3 0.717 79.2 93.4 -69.3 -16.8 61.6 31.5 63.0 95 103 A V S X S- 0 0 3 -3,-3.9 3,-2.0 -4,-0.2 2,-0.5 -0.605 91.3-107.4 -78.4 141.0 61.5 27.9 62.2 96 104 A S T 3 S+ 0 0 40 1,-0.3 35,-0.5 35,-0.3 36,-0.2 -0.535 106.7 20.4 -70.9 116.4 62.5 27.0 58.7 97 105 A G T 3 S+ 0 0 32 -2,-0.5 2,-0.5 1,-0.4 -1,-0.3 0.466 98.2 102.6 105.7 3.9 59.4 25.9 57.0 98 106 A I < + 0 0 8 -3,-2.0 -1,-0.4 -5,-0.3 3,-0.0 -0.988 46.0 171.3-117.6 128.7 56.9 27.6 59.3 99 107 A G > - 0 0 28 -2,-0.5 4,-3.1 -3,-0.1 5,-0.1 -0.595 53.0 -75.7-123.4-174.5 55.5 30.8 57.9 100 108 A P H > S+ 0 0 43 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.889 129.1 52.6 -51.7 -47.7 52.7 32.9 59.1 101 109 A S H > S+ 0 0 89 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.951 112.8 41.2 -57.5 -52.6 50.1 30.6 57.9 102 110 A A H > S+ 0 0 20 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.869 112.1 59.8 -63.4 -36.7 51.5 27.5 59.6 103 111 A A H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 5,-0.3 0.957 104.6 48.4 -55.1 -56.9 52.2 29.7 62.6 104 112 A R H X S+ 0 0 48 -4,-3.2 4,-1.8 1,-0.2 -2,-0.2 0.905 111.2 48.1 -50.7 -52.9 48.6 30.6 62.9 105 113 A K H < S+ 0 0 101 -4,-2.0 3,-0.4 1,-0.2 -1,-0.2 0.942 112.4 50.8 -54.1 -49.3 47.3 27.1 62.7 106 114 A F H ><>S+ 0 0 0 -4,-2.8 5,-4.1 1,-0.2 3,-1.6 0.899 109.8 49.0 -54.6 -45.6 50.0 25.9 65.3 107 115 A V H ><5S+ 0 0 4 -4,-2.3 3,-1.1 1,-0.3 -1,-0.2 0.854 107.0 55.3 -66.5 -32.8 49.1 28.5 67.8 108 116 A D T 3<5S+ 0 0 125 -4,-1.8 -1,-0.3 -3,-0.4 -2,-0.2 0.346 107.1 48.7 -83.4 8.5 45.5 27.8 67.6 109 117 A E T < 5S- 0 0 107 -3,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.162 127.9-106.5-122.6 7.0 46.1 24.3 68.4 110 118 A G T < 5S+ 0 0 39 -3,-1.1 2,-0.9 1,-0.2 -3,-0.3 0.671 73.6 139.2 77.4 24.4 48.1 25.7 71.2 111 119 A I < + 0 0 4 -5,-4.1 -1,-0.2 -6,-0.2 -2,-0.1 -0.847 13.5 149.7 -97.0 106.7 51.7 25.0 70.0 112 120 A K + 0 0 67 -2,-0.9 2,-0.3 -3,-0.1 -1,-0.1 0.419 49.6 38.7-124.1 10.8 53.6 28.0 70.9 113 121 A T S > S- 0 0 57 1,-0.1 4,-2.9 -22,-0.0 3,-0.1 -0.947 84.6 -93.9-150.9 171.2 57.1 27.0 71.6 114 122 A L H > S+ 0 0 36 -2,-0.3 4,-2.5 1,-0.3 5,-0.1 0.862 124.3 50.3 -54.6 -41.7 60.0 24.8 70.7 115 123 A E H > S+ 0 0 137 2,-0.2 4,-2.4 1,-0.2 -1,-0.3 0.911 106.6 54.6 -66.9 -36.3 59.0 22.3 73.1 116 124 A D H > S+ 0 0 44 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.948 109.4 50.7 -56.8 -47.8 55.5 22.3 71.8 117 125 A L H >< S+ 0 0 0 -4,-2.9 3,-0.9 1,-0.2 -2,-0.2 0.949 106.7 50.1 -58.2 -54.2 57.0 21.6 68.5 118 126 A R H >< S+ 0 0 130 -4,-2.5 3,-1.2 1,-0.3 -1,-0.2 0.857 110.2 52.8 -53.3 -38.4 59.1 18.7 69.6 119 127 A K H 3< S+ 0 0 161 -4,-2.4 -1,-0.3 1,-0.3 3,-0.2 0.760 116.0 40.6 -65.8 -29.0 56.0 17.1 71.3 120 128 A N T X< + 0 0 45 -4,-1.5 3,-1.6 -3,-0.9 -1,-0.3 -0.166 69.0 137.4-114.8 40.8 54.1 17.4 68.2 121 129 A E G X + 0 0 94 -3,-1.2 3,-1.3 1,-0.3 -1,-0.2 0.802 66.9 69.4 -55.6 -28.8 56.7 16.5 65.6 122 130 A D G 3 S+ 0 0 111 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.779 91.5 57.3 -61.6 -32.2 54.1 14.5 63.9 123 131 A K G < S+ 0 0 90 -3,-1.6 2,-0.3 -6,-0.2 -1,-0.3 0.116 96.1 83.1 -86.5 22.5 52.2 17.5 62.7 124 132 A L S < S- 0 0 6 -3,-1.3 2,-0.1 -7,-0.1 0, 0.0 -0.950 73.3-131.5-125.4 149.4 55.1 18.9 61.0 125 133 A N > - 0 0 80 -2,-0.3 4,-3.5 -28,-0.2 5,-0.3 -0.326 37.7 -85.7 -92.3 179.4 56.5 18.1 57.5 126 134 A H H > S+ 0 0 111 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.888 126.7 44.3 -49.4 -54.0 60.0 17.2 56.4 127 135 A H H > S+ 0 0 46 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.962 116.1 48.3 -57.3 -51.7 61.2 20.7 55.9 128 136 A Q H > S+ 0 0 9 -31,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.868 109.9 51.7 -56.6 -42.4 59.7 21.8 59.2 129 137 A R H X S+ 0 0 98 -4,-3.5 4,-3.3 1,-0.2 3,-0.3 0.965 112.4 46.2 -61.5 -46.5 61.2 18.9 61.0 130 138 A I H X S+ 0 0 7 -4,-2.5 4,-1.2 -5,-0.3 -2,-0.2 0.907 109.6 53.9 -58.3 -44.4 64.5 19.6 59.7 131 139 A G H < S+ 0 0 1 -4,-2.8 -35,-0.3 -35,-0.5 -1,-0.2 0.806 112.6 44.2 -58.9 -37.6 64.1 23.3 60.5 132 140 A L H >< S+ 0 0 13 -4,-2.1 3,-2.0 -3,-0.3 4,-0.3 0.941 107.2 58.5 -73.3 -51.4 63.2 22.4 64.2 133 141 A K H 3< S+ 0 0 129 -4,-3.3 -2,-0.2 1,-0.3 -1,-0.2 0.732 119.0 30.7 -51.1 -26.8 66.0 19.9 64.4 134 142 A Y T 3X S+ 0 0 17 -4,-1.2 4,-3.1 -5,-0.2 -1,-0.3 0.038 74.8 131.8-123.4 25.7 68.5 22.6 63.6 135 143 A F T <4 S+ 0 0 22 -3,-2.0 -2,-0.1 1,-0.2 -1,-0.1 0.844 81.5 42.3 -42.9 -45.1 66.9 25.7 65.0 136 144 A G T >> S+ 0 0 39 -4,-0.3 3,-3.9 2,-0.2 4,-0.9 1.000 112.9 48.3 -65.9 -71.3 70.1 26.6 66.6 137 145 A D G >4 S+ 0 0 31 1,-0.3 3,-1.0 2,-0.2 -2,-0.2 0.821 110.0 56.7 -36.9 -48.6 72.6 25.8 63.8 138 146 A F G 3< S+ 0 0 45 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.454 102.9 51.2 -69.8 -2.0 70.5 27.7 61.4 139 147 A E G <4 S+ 0 0 105 -3,-3.9 2,-0.4 -5,-0.2 -1,-0.3 0.624 89.5 98.8-108.5 -9.6 70.5 30.8 63.3 140 148 A K S << S- 0 0 103 -3,-1.0 -4,-0.0 -4,-0.9 0, 0.0 -0.596 75.8-124.4 -76.8 125.8 74.2 30.8 63.6 141 149 A R - 0 0 151 -2,-0.4 40,-0.2 1,-0.1 -1,-0.1 -0.017 23.5-116.9 -59.1 170.6 76.0 33.0 61.1 142 150 A I E -A 180 0A 0 38,-3.6 38,-3.2 40,-0.1 2,-0.2 -0.956 23.9-137.9-120.7 112.2 78.6 31.4 58.9 143 151 A P E >> -A 179 0A 38 0, 0.0 3,-3.2 0, 0.0 4,-1.8 -0.417 16.9-122.6 -68.1 134.6 82.1 32.7 59.4 144 152 A R H 3> S+ 0 0 60 34,-4.7 4,-2.0 1,-0.3 5,-0.2 0.762 110.3 62.7 -47.9 -33.9 84.2 33.3 56.3 145 153 A E H 34 S+ 0 0 117 33,-0.4 -1,-0.3 1,-0.2 4,-0.2 0.659 108.1 44.1 -66.5 -19.0 86.9 31.1 57.4 146 154 A E H <> S+ 0 0 25 -3,-3.2 4,-2.4 2,-0.2 -2,-0.2 0.804 106.9 59.1 -88.2 -40.9 84.3 28.3 57.3 147 155 A M H X S+ 0 0 2 -4,-1.8 4,-3.5 1,-0.3 -2,-0.2 0.904 103.9 51.7 -49.8 -52.6 82.9 29.5 54.0 148 156 A L H X S+ 0 0 76 -4,-2.0 4,-1.5 1,-0.2 -1,-0.3 0.742 110.3 50.8 -59.0 -31.4 86.5 29.0 52.4 149 157 A Q H > S+ 0 0 64 -4,-0.2 4,-1.1 -5,-0.2 -1,-0.2 0.918 113.5 43.4 -74.7 -36.9 86.5 25.5 53.8 150 158 A M H X S+ 0 0 2 -4,-2.4 4,-2.6 2,-0.2 3,-0.5 0.936 113.0 52.2 -66.5 -50.0 83.0 24.7 52.3 151 159 A Q H X S+ 0 0 57 -4,-3.5 4,-2.6 1,-0.3 5,-0.3 0.923 105.8 54.9 -52.5 -50.1 83.8 26.2 49.1 152 160 A D H X S+ 0 0 86 -4,-1.5 4,-1.3 1,-0.2 -1,-0.3 0.836 110.0 46.1 -57.2 -35.7 86.9 24.2 48.8 153 161 A I H X S+ 0 0 39 -4,-1.1 4,-2.1 -3,-0.5 -2,-0.2 0.976 112.8 47.4 -71.9 -51.8 85.0 21.0 49.3 154 162 A V H X S+ 0 0 2 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.930 112.4 49.8 -51.6 -55.6 82.2 21.8 46.8 155 163 A L H X S+ 0 0 56 -4,-2.6 4,-2.0 1,-0.3 -1,-0.2 0.911 111.7 47.7 -56.1 -45.3 84.5 22.9 44.1 156 164 A N H X S+ 0 0 84 -4,-1.3 4,-1.8 -5,-0.3 -1,-0.3 0.844 113.6 48.8 -66.2 -32.0 86.7 19.9 44.3 157 165 A E H X S+ 0 0 24 -4,-2.1 4,-1.8 -3,-0.2 -2,-0.2 0.897 109.5 48.6 -74.9 -41.7 83.7 17.6 44.3 158 166 A V H X S+ 0 0 6 -4,-2.9 4,-1.9 2,-0.2 7,-0.2 0.928 108.5 58.2 -62.3 -40.0 82.0 19.1 41.4 159 167 A K H >< S+ 0 0 136 -4,-2.0 3,-0.6 -5,-0.3 -2,-0.2 0.962 104.0 49.5 -54.6 -55.1 85.3 18.9 39.5 160 168 A K H 3< S+ 0 0 126 -4,-1.8 -1,-0.2 1,-0.2 3,-0.2 0.880 108.1 53.7 -54.1 -39.8 85.6 15.2 40.0 161 169 A V H 3< S- 0 0 47 -4,-1.8 -1,-0.2 1,-0.2 2,-0.2 0.880 133.9 -12.9 -64.9 -36.1 82.1 14.5 38.7 162 170 A D X< - 0 0 53 -4,-1.9 3,-2.2 -3,-0.6 -1,-0.2 -0.691 52.7-146.1-170.4 115.2 82.7 16.5 35.5 163 171 A S T 3 S+ 0 0 85 1,-0.3 -4,-0.1 -2,-0.2 -3,-0.1 0.567 97.9 67.2 -54.7 -18.8 85.6 18.8 34.5 164 172 A E T 3 S+ 0 0 111 -5,-0.1 -1,-0.3 2,-0.1 2,-0.1 0.367 74.5 105.5 -86.0 -2.7 83.2 20.8 32.6 165 173 A Y < - 0 0 19 -3,-2.2 2,-0.5 -7,-0.2 24,-0.2 -0.444 54.2-153.6 -79.3 161.2 81.1 22.1 35.4 166 174 A I E -B 188 0B 51 22,-1.9 22,-1.4 -2,-0.1 2,-0.4 -0.923 16.3-179.4-133.4 109.5 81.4 25.6 36.4 167 175 A A E -B 187 0B 23 -2,-0.5 2,-0.3 20,-0.2 20,-0.2 -0.844 3.4-179.8-110.9 148.8 80.5 26.4 40.0 168 176 A T E -B 186 0B 30 18,-1.5 18,-3.1 -2,-0.4 2,-0.8 -0.992 22.0-140.2-145.5 134.1 80.5 29.8 41.7 169 177 A V E -B 185 0B 8 -2,-0.3 16,-0.2 16,-0.2 -2,-0.0 -0.830 31.6-177.1 -99.1 115.5 79.6 30.8 45.3 170 178 A C + 0 0 4 14,-2.3 3,-0.5 -2,-0.8 14,-0.3 -0.050 31.2 74.9 -94.0-159.1 77.8 34.0 45.3 171 179 A G S >> S- 0 0 21 93,-0.3 3,-1.6 1,-0.2 4,-1.3 -0.250 106.9 -44.7 85.3-177.3 76.4 36.2 47.9 172 180 A S T 34 S+ 0 0 26 1,-0.3 -1,-0.2 2,-0.3 4,-0.2 0.720 129.2 76.4 -59.2 -22.9 78.3 38.6 50.1 173 181 A F T 34 S+ 0 0 15 -3,-0.5 3,-0.5 1,-0.2 -1,-0.3 0.878 104.2 39.6 -48.6 -40.9 80.8 35.7 50.6 174 182 A R T <4 S+ 0 0 54 -3,-1.6 -2,-0.3 1,-0.2 -1,-0.2 0.771 107.7 58.2 -73.8 -45.0 81.8 36.8 47.1 175 183 A R S < S- 0 0 67 -4,-1.3 2,-0.5 90,-0.1 -1,-0.2 0.307 126.7 -98.3 -76.1 13.9 81.5 40.5 47.8 176 184 A G + 0 0 30 -3,-0.5 -1,-0.1 1,-0.2 -3,-0.1 -0.557 64.6 161.7 110.7 -68.2 84.1 39.9 50.6 177 185 A A - 0 0 37 -2,-0.5 -1,-0.2 1,-0.1 3,-0.0 0.641 41.5-130.8 7.8 130.6 82.0 39.7 53.8 178 186 A E S S+ 0 0 138 -35,-0.1 -34,-4.7 -34,-0.1 -33,-0.4 0.606 84.9 2.2 -69.5 -22.4 83.3 38.1 57.1 179 187 A S E -A 143 0A 33 -36,-0.3 2,-0.3 -35,-0.1 -38,-0.0 -0.946 69.3-162.8-156.7 171.9 80.5 35.8 57.7 180 188 A S E -A 142 0A 3 -38,-3.2 -38,-3.6 -2,-0.3 3,-0.1 -0.965 29.0-116.7-160.3 169.2 77.3 34.9 56.1 181 189 A G S S- 0 0 38 -2,-0.3 65,-0.4 -40,-0.2 2,-0.2 0.855 84.7 -20.6 -73.9 -50.5 73.9 33.4 56.4 182 190 A D - 0 0 84 63,-0.1 2,-0.5 -40,-0.1 65,-0.2 -0.926 67.5 -94.0-155.3 172.1 74.0 30.3 54.0 183 191 A M E - c 0 247B 1 63,-2.6 65,-3.3 -2,-0.2 2,-0.5 -0.909 31.5-172.2-107.1 127.1 75.9 29.0 51.0 184 192 A D E - c 0 248B 27 -2,-0.5 -14,-2.3 -14,-0.3 2,-0.5 -0.974 3.8-168.0-118.6 111.6 74.6 29.6 47.4 185 193 A V E -Bc 169 249B 3 63,-3.1 65,-2.7 -2,-0.5 2,-0.6 -0.896 10.7-151.2-106.6 126.2 76.2 27.9 44.6 186 194 A L E -Bc 168 250B 2 -18,-3.1 -18,-1.5 -2,-0.5 2,-0.4 -0.854 22.6-165.0 -95.3 116.1 75.5 29.0 41.0 187 195 A L E +Bc 167 251B 2 63,-3.2 65,-2.6 -2,-0.6 2,-0.3 -0.911 14.2 164.6-113.9 141.8 76.0 25.9 38.8 188 196 A T E -Bc 166 252B 0 -22,-1.4 -22,-1.9 -2,-0.4 3,-0.1 -0.918 15.3-163.5-145.0 165.4 76.3 25.7 35.0 189 197 A H E > - c 0 253B 12 63,-0.6 3,-1.0 3,-0.4 65,-0.8 -0.981 27.7-129.3-153.1 145.4 77.4 23.3 32.3 190 198 A P T 3 S+ 0 0 64 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.895 110.3 61.1 -61.8 -42.9 78.3 23.8 28.6 191 199 A S T 3 S+ 0 0 56 1,-0.1 2,-0.3 -27,-0.1 11,-0.1 0.023 99.8 68.3 -75.8 32.3 75.9 21.1 27.7 192 200 A F < + 0 0 15 -3,-1.0 62,-5.6 -2,-0.6 -3,-0.4 -0.813 60.1 137.6-157.7 111.8 72.9 23.1 29.2 193 201 A T - 0 0 35 60,-0.4 5,-0.1 -2,-0.3 3,-0.1 -0.981 62.6 -66.4-154.7 165.6 71.5 26.2 27.9 194 202 A S S S+ 0 0 65 -2,-0.3 -1,-0.0 1,-0.2 0, 0.0 0.554 127.9 22.4 -13.2 -58.2 68.5 28.3 27.1 195 203 A E S S+ 0 0 166 2,-0.1 -1,-0.2 3,-0.0 3,-0.1 0.929 93.0 110.9 -84.1 -51.3 67.1 26.0 24.3 196 204 A S S S- 0 0 39 1,-0.2 2,-1.4 -3,-0.1 3,-0.1 0.163 79.1-115.9 -26.9 115.8 68.8 22.7 25.2 197 205 A T - 0 0 136 1,-0.1 -1,-0.2 -5,-0.0 -2,-0.1 -0.506 56.0 -79.6 -73.3 101.0 66.1 20.5 26.4 198 206 A K - 0 0 90 -2,-1.4 -5,-0.1 1,-0.1 -1,-0.1 0.558 29.4-153.9 35.8 178.8 67.0 19.8 29.9 199 207 A Q + 0 0 84 25,-0.2 4,-0.3 -7,-0.1 -1,-0.1 -0.355 13.2 176.2 171.5 92.1 69.4 17.6 31.7 200 208 A P S >> S+ 0 0 51 0, 0.0 4,-2.0 0, 0.0 3,-1.0 0.801 80.7 64.6 -76.5 -35.5 68.2 16.8 35.2 201 209 A K H 3> S+ 0 0 112 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.747 86.2 78.4 -60.2 -21.2 71.1 14.5 35.9 202 210 A L H 3> S+ 0 0 4 2,-0.2 4,-0.6 1,-0.2 -1,-0.3 0.921 107.6 23.7 -51.1 -53.0 73.0 17.7 35.5 203 211 A L H <> S+ 0 0 0 -3,-1.0 4,-2.4 -4,-0.3 3,-0.5 0.888 119.5 58.4 -77.6 -49.4 72.1 18.8 39.1 204 212 A H H X S+ 0 0 42 -4,-2.0 4,-1.9 1,-0.3 -3,-0.2 0.787 100.0 59.2 -54.1 -35.0 71.3 15.4 40.7 205 213 A Q H X S+ 0 0 74 -4,-2.0 4,-1.7 -5,-0.3 -1,-0.3 0.948 109.1 42.0 -64.3 -45.9 74.8 14.2 39.9 206 214 A V H X S+ 0 0 1 -4,-0.6 4,-2.7 -3,-0.5 3,-0.4 0.960 112.1 53.2 -64.5 -49.5 76.4 16.9 41.9 207 215 A V H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.3 -1,-0.2 0.883 109.1 52.2 -51.5 -41.3 74.0 16.7 44.8 208 216 A E H X S+ 0 0 111 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.3 0.885 106.8 49.8 -66.6 -39.1 74.7 13.0 44.9 209 217 A Q H X S+ 0 0 30 -4,-1.7 4,-2.6 -3,-0.4 6,-0.3 0.968 107.8 56.8 -64.6 -45.3 78.5 13.4 45.1 210 218 A L H <>S+ 0 0 0 -4,-2.7 5,-3.0 1,-0.3 6,-1.3 0.891 111.9 40.1 -51.8 -40.6 78.0 15.9 47.9 211 219 A Q H ><5S+ 0 0 70 -4,-1.7 3,-2.0 3,-0.2 -1,-0.3 0.869 106.7 64.7 -78.4 -32.5 76.1 13.4 49.9 212 220 A K H 3<5S+ 0 0 148 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.932 110.7 37.5 -54.3 -45.2 78.5 10.6 48.9 213 221 A V T 3<5S- 0 0 57 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 0.195 118.8-115.9 -90.6 16.3 81.2 12.4 50.8 214 222 A H T < 5S+ 0 0 149 -3,-2.0 -3,-0.2 -5,-0.2 18,-0.2 0.769 80.2 122.5 60.0 29.2 78.8 13.4 53.5 215 223 A F < + 0 0 4 -5,-3.0 17,-2.0 -6,-0.3 2,-0.5 0.862 69.4 53.9 -86.5 -35.8 79.0 17.1 52.9 216 224 A I E +D 231 0B 4 -6,-1.3 15,-0.3 15,-0.3 -1,-0.2 -0.888 65.5 177.8 -98.1 131.2 75.3 17.4 52.3 217 225 A T E + 0 0 50 13,-4.6 2,-0.3 -2,-0.5 14,-0.2 0.612 58.2 10.6-104.9 -25.2 73.3 15.9 55.2 218 226 A D E -D 230 0B 26 12,-1.0 12,-2.1 -88,-0.0 2,-0.5 -0.966 63.1-128.3-155.8 154.6 69.6 16.5 54.5 219 227 A T E +D 229 0B 32 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.928 18.9 176.4-112.3 130.0 67.4 17.7 51.6 220 228 A L E S- 0 0 19 8,-3.8 2,-0.4 -2,-0.5 9,-0.2 0.855 80.1 -9.1 -93.6 -56.8 64.9 20.4 52.1 221 229 A S E -D 228 0B 48 7,-1.7 7,-2.9 -94,-0.1 2,-0.5 -0.984 62.0-169.9-144.4 128.9 63.7 20.6 48.6 222 230 A K E +D 227 0B 94 -2,-0.4 5,-0.2 5,-0.2 2,-0.1 -0.857 19.9 158.8-127.3 103.0 65.2 18.8 45.5 223 231 A G - 0 0 36 3,-2.7 -19,-0.1 -2,-0.5 -20,-0.0 -0.028 55.7 -87.6 -99.6-157.9 63.9 19.9 42.1 224 232 A E S S+ 0 0 99 1,-0.1 -21,-0.3 -21,-0.1 -25,-0.2 0.479 122.0 12.6 -99.0 3.4 65.4 19.6 38.6 225 233 A T S S+ 0 0 50 1,-0.3 26,-2.7 -22,-0.1 2,-0.4 0.413 123.8 55.0-150.2 -4.8 67.2 22.8 38.7 226 234 A K E - E 0 250B 92 24,-0.2 -3,-2.7 2,-0.0 2,-0.4 -0.987 54.5-172.0-141.7 127.8 67.2 23.9 42.3 227 235 A F E -DE 222 249B 0 22,-2.6 22,-3.0 -2,-0.4 2,-0.4 -0.982 4.0-167.6-123.6 135.5 68.3 22.1 45.3 228 236 A M E +DE 221 248B 37 -7,-2.9 -8,-3.8 -2,-0.4 -7,-1.7 -0.972 34.4 137.6-118.1 103.0 67.7 23.3 49.0 229 237 A G E -DE 219 247B 0 18,-4.1 18,-2.2 -2,-0.4 2,-0.3 -0.510 49.7-101.3-133.4-157.0 69.7 21.4 51.6 230 238 A V E -DE 218 246B 0 -12,-2.1 -13,-4.6 16,-0.3 -12,-1.0 -1.000 32.6-178.0-135.5 126.2 71.9 21.1 54.7 231 239 A C E -DE 216 245B 0 14,-2.9 14,-2.6 -2,-0.3 2,-0.3 -0.823 7.5-160.6-124.5 169.4 75.6 20.6 54.7 232 240 A Q - 0 0 24 -17,-2.0 12,-0.1 -2,-0.3 3,-0.1 -0.863 22.5-127.0-155.2 119.3 78.3 20.2 57.2 233 241 A L - 0 0 7 10,-0.3 9,-0.7 -2,-0.3 3,-0.1 -0.481 51.5-101.9 -64.0 121.9 82.1 20.6 57.4 234 242 A P - 0 0 77 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.027 33.3-108.4 -43.4 138.4 83.3 17.2 58.7 235 243 A S - 0 0 27 1,-0.2 3,-0.4 -3,-0.1 6,-0.2 -0.702 35.5-148.3 -79.6 120.3 84.2 17.2 62.2 236 244 A K S S- 0 0 109 -2,-0.6 2,-0.8 4,-0.4 -1,-0.2 0.969 70.9 -12.0 -45.8-108.9 88.1 16.9 62.4 237 245 A N S S- 0 0 142 3,-0.1 -1,-0.2 4,-0.0 3,-0.1 -0.789 103.7 -97.0-109.1 78.5 89.6 15.1 65.3 238 246 A D S S+ 0 0 106 -2,-0.8 3,-0.1 -3,-0.4 -3,-0.0 0.451 99.2 82.0 -9.7 113.2 86.4 14.9 67.4 239 247 A E S S+ 0 0 172 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 -0.098 96.3 44.6 176.4 -34.9 85.9 17.5 70.2 240 248 A K + 0 0 126 -3,-0.1 -4,-0.4 2,-0.0 2,-0.2 -0.859 65.2 178.6-132.9 97.5 84.5 20.2 67.9 241 249 A E - 0 0 112 -2,-0.4 -6,-0.1 -6,-0.2 -8,-0.0 -0.624 33.1-107.8 -91.2 156.8 81.9 19.2 65.3 242 250 A Y - 0 0 37 -9,-0.7 -7,-0.1 -2,-0.2 -1,-0.1 -0.557 28.1-101.2 -93.4 157.4 80.4 22.0 63.1 243 251 A P - 0 0 23 0, 0.0 2,-0.5 0, 0.0 -10,-0.3 -0.252 44.4-101.5 -61.3 156.0 77.1 23.6 63.1 244 252 A H - 0 0 21 -12,-0.1 2,-0.3 -110,-0.1 -12,-0.2 -0.747 45.2-157.2 -83.7 125.6 74.6 22.4 60.4 245 253 A R E - E 0 231B 17 -14,-2.6 -14,-2.9 -2,-0.5 2,-0.3 -0.798 14.8-115.7-112.8 151.9 74.4 25.0 57.6 246 254 A R E - E 0 230B 35 -65,-0.4 -63,-2.6 -2,-0.3 2,-0.4 -0.615 33.9-171.3 -81.0 133.8 71.9 25.9 54.9 247 255 A I E -cE 183 229B 0 -18,-2.2 -18,-4.1 -2,-0.3 2,-0.5 -0.983 14.4-162.8-140.6 137.9 72.9 25.4 51.3 248 256 A D E -cE 184 228B 25 -65,-3.3 -63,-3.1 -2,-0.4 2,-0.6 -0.935 4.1-173.4-115.3 123.1 71.5 26.2 48.0 249 257 A I E -cE 185 227B 3 -22,-3.0 -22,-2.6 -2,-0.5 2,-0.4 -0.931 8.8-176.8-116.1 114.2 72.5 24.6 44.8 250 258 A R E -cE 186 226B 39 -65,-2.7 -63,-3.2 -2,-0.6 2,-0.3 -0.938 18.3-144.4-119.5 129.6 71.0 26.0 41.5 251 259 A L E -c 187 0B 6 -26,-2.7 -63,-0.2 -2,-0.4 -48,-0.0 -0.596 22.9-171.9 -78.2 132.4 71.5 24.7 37.8 252 260 A I E -c 188 0B 32 -65,-2.6 -63,-0.6 -2,-0.3 5,-0.1 -0.985 31.2-107.1-131.6 139.0 71.6 27.6 35.2 253 261 A P E > -c 189 0B 19 0, 0.0 3,-2.4 0, 0.0 -60,-0.4 -0.452 34.6-124.6 -58.0 132.1 71.7 27.4 31.4 254 262 A K G > S+ 0 0 65 -62,-5.6 3,-1.4 -65,-0.8 4,-0.3 0.839 106.7 68.0 -50.1 -39.1 75.2 28.3 30.4 255 263 A D G 3 S+ 0 0 75 -63,-0.3 -1,-0.3 1,-0.2 50,-0.3 0.492 109.7 35.6 -61.7 -1.0 73.9 31.0 28.1 256 264 A Q G <> S+ 0 0 32 -3,-2.4 4,-1.0 33,-0.1 -1,-0.2 0.301 83.2 107.5-137.4 15.6 72.8 33.0 31.2 257 265 A Y H X> S+ 0 0 2 -3,-1.4 4,-2.5 -4,-0.3 3,-2.0 0.981 77.6 48.0 -56.3 -75.8 75.4 32.3 34.0 258 266 A Y H 3> S+ 0 0 39 -4,-0.3 4,-0.9 1,-0.3 -1,-0.2 0.651 109.4 55.3 -46.6 -22.9 77.3 35.6 34.3 259 267 A C H 3> S+ 0 0 5 29,-0.3 4,-2.1 -3,-0.2 -1,-0.3 0.832 114.5 40.3 -78.3 -33.8 74.0 37.5 34.4 260 268 A G H < S+ 0 0 7 -4,-0.9 3,-0.8 -5,-0.4 4,-0.3 0.999 116.4 41.1 -65.9 -61.1 76.3 39.0 38.5 263 271 A Y H >< S+ 0 0 64 -4,-2.1 3,-1.6 1,-0.2 -2,-0.2 0.803 113.6 50.2 -46.6 -57.9 72.9 39.5 40.0 264 272 A F H 3< S+ 0 0 66 -4,-3.9 -93,-0.3 1,-0.3 -1,-0.2 0.696 101.6 65.5 -57.1 -31.3 73.2 36.9 42.9 265 273 A T T << S+ 0 0 0 -4,-1.0 -1,-0.3 -3,-0.8 -2,-0.2 0.584 92.3 145.1 -68.1 -16.7 76.5 38.5 43.9 266 274 A G < - 0 0 2 -3,-1.6 2,-0.2 -4,-0.3 -1,-0.2 -0.006 61.3-160.9 50.7-157.2 74.6 41.7 44.8 267 275 A S >> - 0 0 9 59,-0.1 4,-2.3 -3,-0.1 3,-0.6 0.652 36.8-132.0 -76.4 165.4 74.6 43.9 46.7 268 276 A D H 3> S+ 0 0 118 1,-0.3 4,-1.9 2,-0.2 -2,-0.1 0.831 109.4 47.8 -48.8 -41.1 71.0 45.0 46.1 269 277 A I H 3> S+ 0 0 78 57,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.782 107.5 56.1 -70.2 -32.7 72.1 48.6 45.8 270 278 A F H <> S+ 0 0 0 -3,-0.6 4,-2.4 56,-0.6 -2,-0.2 0.981 108.4 47.0 -61.7 -54.6 74.9 47.5 43.5 271 279 A N H X S+ 0 0 11 -4,-2.3 4,-3.7 2,-0.2 5,-0.2 0.881 109.1 55.1 -49.4 -51.9 72.4 45.9 41.1 272 280 A K H X S+ 0 0 141 -4,-1.9 4,-2.9 1,-0.2 5,-0.3 0.962 111.4 41.3 -50.0 -68.6 70.1 48.8 41.2 273 281 A N H X S+ 0 0 86 -4,-2.0 4,-2.7 1,-0.3 -1,-0.2 0.848 116.1 49.3 -50.1 -42.5 72.7 51.3 40.1 274 282 A M H X S+ 0 0 2 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.3 0.940 114.2 46.8 -61.8 -45.5 74.2 49.0 37.6 275 283 A R H X S+ 0 0 79 -4,-3.7 4,-1.6 -3,-0.3 -2,-0.2 0.870 112.6 49.2 -60.4 -45.0 70.7 48.3 36.2 276 284 A A H X S+ 0 0 57 -4,-2.9 4,-0.9 -5,-0.2 -1,-0.2 0.847 112.5 47.8 -66.2 -36.9 69.8 52.0 36.2 277 285 A H H >X S+ 0 0 40 -4,-2.7 4,-2.4 -5,-0.3 3,-0.7 0.937 105.4 58.9 -69.4 -40.3 73.1 52.8 34.4 278 286 A A H 3<>S+ 0 0 0 -4,-2.4 5,-1.2 1,-0.3 -2,-0.2 0.853 104.3 53.2 -46.6 -47.4 72.4 49.9 31.8 279 287 A L H ><5S+ 0 0 70 -4,-1.6 3,-0.8 3,-0.2 -1,-0.3 0.752 106.9 51.0 -61.5 -35.5 69.2 51.8 31.0 280 288 A E H <<5S+ 0 0 135 -4,-0.9 -2,-0.2 -3,-0.7 -1,-0.2 0.992 105.3 54.3 -68.6 -55.6 71.1 54.8 30.4 281 289 A K T 3<5S- 0 0 82 -4,-2.4 -1,-0.2 1,-0.1 -2,-0.2 0.222 132.5 -87.5 -60.1 11.5 73.6 53.1 28.0 282 290 A G T < 5S+ 0 0 34 -3,-0.8 11,-2.1 1,-0.2 2,-0.3 0.890 91.2 118.8 77.9 46.0 70.7 51.8 25.8 283 291 A F E < -F 292 0C 29 -5,-1.2 2,-0.4 9,-0.3 -1,-0.2 -0.967 51.5-149.8-150.7 161.7 70.1 48.6 27.9 284 292 A T E -F 291 0C 33 7,-2.2 7,-2.5 -2,-0.3 2,-0.4 -0.949 17.6-178.1-130.4 141.1 68.2 46.2 30.0 285 293 A I E +F 290 0C 18 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.986 10.1 148.0-143.0 150.8 69.2 43.7 32.6 286 294 A N - 0 0 35 3,-1.6 -23,-0.2 -2,-0.4 3,-0.0 -0.893 65.0 -59.5-157.0-175.8 67.9 41.2 34.8 287 295 A E S S+ 0 0 73 -2,-0.3 -24,-0.2 1,-0.2 -23,-0.1 0.764 129.2 26.1 -47.0 -31.0 68.6 38.0 36.5 288 296 A Y S S+ 0 0 127 1,-0.2 2,-0.3 -29,-0.1 -29,-0.3 0.749 119.3 0.0-110.8 -26.4 69.1 36.2 33.1 289 297 A T - 0 0 21 -30,-0.2 -3,-1.6 -31,-0.1 2,-0.5 -0.968 50.1-124.4-156.0 173.3 70.2 38.5 30.3 290 298 A I E -F 285 0C 0 13,-0.4 13,-1.9 -2,-0.3 -5,-0.2 -0.991 32.5-162.6-125.7 130.5 71.1 42.0 29.2 291 299 A R E -F 284 0C 95 -7,-2.5 -7,-2.2 -2,-0.5 2,-0.2 -0.965 23.0-117.8-128.0 136.8 69.2 43.4 26.2 292 300 A P E -F 283 0C 42 0, 0.0 2,-0.5 0, 0.0 -9,-0.3 -0.455 39.3-127.4 -62.9 127.4 69.7 46.2 23.7 293 301 A L - 0 0 55 -11,-2.1 7,-0.1 -2,-0.2 5,-0.1 -0.715 15.5-147.1 -90.4 126.1 66.9 48.7 24.2 294 302 A G - 0 0 28 -2,-0.5 3,-0.2 5,-0.3 5,-0.1 -0.228 17.5-126.9 -76.2 174.5 64.9 49.8 21.2 295 303 A V S S+ 0 0 145 1,-0.1 4,-0.1 -13,-0.0 -1,-0.1 0.612 92.6 87.2-100.9 -10.8 63.5 53.3 21.1 296 304 A T S S- 0 0 130 2,-0.4 2,-0.2 1,-0.1 -1,-0.1 0.490 125.8 -82.1 -63.8 -3.8 59.8 52.3 20.4 297 305 A G S S+ 0 0 46 1,-0.2 2,-0.2 -3,-0.2 -1,-0.1 -0.690 102.4 1.1 134.4 -70.3 59.7 52.1 24.0 298 306 A V + 0 0 109 -2,-0.2 -2,-0.4 -5,-0.1 -1,-0.2 -0.460 60.9 161.8-126.2-164.0 61.1 48.8 24.6 299 307 A A - 0 0 45 -2,-0.2 -5,-0.3 -3,-0.1 -8,-0.0 -0.498 16.7-149.1 150.8 146.8 62.5 45.9 22.6 300 308 A G + 0 0 38 -2,-0.2 -9,-0.0 -7,-0.1 -10,-0.0 -0.003 29.4 146.2-112.0-143.7 64.6 42.9 23.1 301 309 A E - 0 0 150 -10,-0.1 2,-0.3 2,-0.1 -11,-0.0 0.773 53.4-101.7 97.9 97.8 67.1 40.3 21.9 302 310 A P - 0 0 74 0, 0.0 -11,-0.2 0, 0.0 -2,-0.0 -0.211 28.0-146.1 -45.7 99.2 69.8 38.7 24.2 303 311 A L - 0 0 43 -13,-1.9 2,-0.5 -2,-0.3 -13,-0.4 -0.253 31.4-106.6 -61.5 156.3 73.2 40.2 23.8 304 312 A P - 0 0 100 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.873 35.2-168.8-104.2 127.6 75.8 37.5 24.4 305 313 A V + 0 0 27 -2,-0.5 -47,-0.1 -50,-0.3 -48,-0.1 -0.856 23.0 173.4-111.7 136.4 78.0 37.3 27.5 306 314 A D S S- 0 0 115 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.374 77.3 -2.3-116.6 -7.5 81.2 35.2 28.4 307 315 A S S >> S- 0 0 40 -50,-0.0 4,-1.3 1,-0.0 3,-0.6 -0.960 82.2 -88.8-173.8 168.4 81.9 36.8 31.8 308 316 A E H 3> S+ 0 0 4 -2,-0.3 4,-1.7 1,-0.3 5,-0.1 0.704 124.5 67.0 -60.4 -18.0 80.8 39.4 34.2 309 317 A K H 3> S+ 0 0 85 2,-0.2 4,-3.0 1,-0.2 -1,-0.3 0.924 92.6 55.3 -66.4 -50.5 83.2 41.5 32.1 310 318 A D H <> S+ 0 0 42 -3,-0.6 4,-2.5 1,-0.2 -2,-0.2 0.932 106.2 53.5 -49.1 -53.2 81.0 41.2 29.0 311 319 A I H X S+ 0 0 0 -4,-1.3 4,-1.8 1,-0.2 -1,-0.2 0.923 111.8 42.3 -48.9 -56.7 78.2 42.7 31.0 312 320 A F H <>S+ 0 0 0 -4,-1.7 5,-0.5 2,-0.2 -1,-0.2 0.934 111.1 56.4 -55.5 -52.6 80.1 45.8 32.2 313 321 A D H ><5S+ 0 0 76 -4,-3.0 3,-3.1 1,-0.2 -1,-0.2 0.900 104.2 54.6 -41.1 -61.3 81.7 46.3 28.8 314 322 A Y H 3<5S+ 0 0 67 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.873 112.2 39.8 -40.1 -62.8 78.3 46.5 27.2 315 323 A I T 3<5S- 0 0 0 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.357 116.0-122.5 -75.7 10.8 77.0 49.2 29.5 316 324 A Q T < 5 + 0 0 124 -3,-3.1 2,-0.3 1,-0.2 -3,-0.2 0.956 61.3 135.7 45.8 78.6 80.5 50.6 29.1 317 325 A W < - 0 0 64 -5,-0.5 2,-0.4 3,-0.0 -1,-0.2 -0.910 60.7 -74.7-146.2 171.0 81.5 50.8 32.7 318 326 A K - 0 0 123 -2,-0.3 2,-0.2 1,-0.1 -6,-0.0 -0.557 49.2-118.5 -72.3 119.1 84.4 50.1 35.2 319 327 A Y - 0 0 93 -2,-0.4 2,-0.5 1,-0.1 -1,-0.1 -0.450 34.2-152.2 -61.7 123.7 84.8 46.4 35.9 320 328 A R - 0 0 45 -2,-0.2 -1,-0.1 2,-0.0 -8,-0.1 -0.927 9.4-130.7-107.3 122.4 84.2 46.1 39.5 321 329 A E > - 0 0 140 -2,-0.5 3,-1.0 1,-0.1 -146,-0.0 -0.349 35.8-107.6 -63.4 145.9 85.8 43.4 41.6 322 330 A P G > S+ 0 0 20 0, 0.0 3,-2.5 0, 0.0 -147,-0.1 0.856 116.1 66.5 -44.6 -45.5 83.1 41.8 43.6 323 331 A K G > S+ 0 0 134 1,-0.3 3,-0.5 -149,-0.2 -146,-0.1 0.857 103.3 43.2 -44.2 -53.2 84.5 43.5 46.8 324 332 A D G < S+ 0 0 61 -3,-1.0 -1,-0.3 1,-0.2 3,-0.2 0.117 83.6 99.9 -86.2 24.3 83.6 47.0 45.6 325 333 A R G < + 0 0 0 -3,-2.5 -1,-0.2 1,-0.2 -55,-0.2 0.286 51.7 112.1 -88.6 10.7 80.2 45.8 44.4 326 334 A S < 0 0 65 -3,-0.5 -56,-0.6 1,-0.2 -57,-0.2 0.956 360.0 360.0 -48.1 -79.1 78.9 47.2 47.5 327 335 A E 0 0 159 -3,-0.2 -1,-0.2 -58,-0.2 -2,-0.1 0.272 360.0 360.0-132.2 360.0 76.9 50.2 46.4